3-methyl-4-nitro-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzamide

Systemtic Name: 3-methyl-4-nitro-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzamide Openeye Name: 3-methyl-4-nitro-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]benzamide CAS Name: 3-methyl-4-nitro-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzamide IUPAC Name: 3-methyl-4-nitro-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzamide Traditional Name: 3-methyl-4-nitro-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]benzamide Formula: C16H12N4O7 MolecularWeight: 372.28908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NN=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N/N=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O7/c1-9-4-10(2-3-12(9)19(22)23)16(21)18-17-7-11-5-14-15(27-8-26-14)6-13(11)20(24)25/h2-7H,8H2,1H3,(H,18,21)/b17-7+